SMILES:
COCCCCCC(=O)c1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C14H18O4
Molecular weight
250.29
Exact mass
250.1205
XLogP
2.8
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
67.24
Supplementary Information
상세 정보 불러오는 중…
2개 반응에 참여→